BIOPEP-UWM: Report

ID 641
Name ACE inhibitor
sequence
PV
Function:
Predicted inhibitor of Angiotensin-Converting Enzyme (ACE) (EC 3.4.15.1) (MEROPS ID: M02-001)
 
Number of residues
2
Activity code
ah
Activity :
ACE inhibitor
Chemical mass 214.2608 Monoisotopic mass 214.1313
EC50 :
0.00 µM


Bibliographic data:
Authors
Gu J., Yue S., Yang X., Lu Z., Wang Z., Wei X., Zhou L., Zhao Z., Shi Z., Zhao Z.
Title
Unlocking novel angiotensin-converting enzyme inhibitory peptides from Nili Ravi buffalo milk β-casein: A synergistic strategy combining targeted hydrolysis, 3D-QSAR modeling, and mechanistic insights. Food Biosci., 71, 107346, 2025
Year Source
2025 Journal


Additional information:
BIOPEP-UWM Virtual database



SMILES: N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(C(C)C)C(=O)O

InChI=1S/C10H18N2O3/c1-6(2)8(10(14)15)12-9(13)7-4-3-5-11-7/h6-8,11H,3-5H2,1-2H3,(H,12,13)(H,14,15)/t7-,8-/m0/s1

InChIKey=AWJGUZSYVIVZGP-YUMQZZPRSA-N


Activity predicted using QSAR


Inhibitor of Dipeptidyl Peptidase IV (EC 3.4.14.5) (MEROPS ID: S09.003) according to the BIOPEP-UWM database of bioactive peptides (ID 8864)


Database reference:
ACToR: ID 20488-27-1

BIOPEP-UWM database of bioactive peptides: ID 8864

BRENDA: Ligand Pro-Val

CAS: REgistry No 52899-09-9

ChEBI: ID 74800

ChEMBL: ID CHEMBL59096

ChemSpider: ID 134246

ECHA: ID 109-172-2

EPA DSSTox: ID DTXSID90942662

J-GLOBAL: ID 200907005683208533

MetaboLights: ID MTBLC74800

Nikkaji: ID J149.646H

NMRShiftDB: ID 60021756

PubChem: CID 152307

SureChEMBL: ID 6401404

UniChem: ID 436133

Wikidata: ID Q27144911

ZINC: ID ZINC000001572030